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1-((2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3,17-dihydroxy-10,13-dimethyl-2-(piperidin-1-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-16-yl)-1-methylpiperidin-1-ium bromide

Catalog No. :
ACDOLF988
CAS No. :
73319-30-9
Molecular Formula :
C30H53BrN2O2
Molecular Weight :
553.67

IUPAC Name:1-((2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3,17-dihydroxy-10,13-dimethyl-2-(piperidin-1-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-16-yl)-1-methylpiperidin-1-ium bromide

1-((2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3,17-dihydroxy-10,13-dimethyl-2-(piperidin-1-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-16-yl)-1-methylpiperidin-1-ium bromide structure diagram
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Product Information

Product Name1-((2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3,17-dihydroxy-10,13-dimethyl-2-(piperidin-1-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-16-yl)-1-methylpiperidin-1-ium bromide
IUPAC Name1-((2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3,17-dihydroxy-10,13-dimethyl-2-(piperidin-1-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-16-yl)-1-methylpiperidin-1-ium bromide
Molecular FormulaC30H53BrN2O2
Molecular Weight553.67
SMILESC[C@]12C[C@H](N3CCCCC3)[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)[C@@H]([N+]3(C)CCCCC3)C[C@@H]12.[Br-]
InChI KeyDIGWZHJLXJPNBY-DSBFZBMTSA-M
Synonym3,17-bis-deacetylvecuronium;1-[(2β,3α,5α,16β17β)-3,17-Dihydroxy-2-(1-piperidinyl)androstan-16-yl]-1-Methyl piperidiniuM BroMide;VecuroniuM BroMide Related CoMpound C;1-[(2beta,3alpha,5alpha,16beta,17beta)-3,17-Dihydroxy-2-(1-piperidinyl)androstan-16-yl]-1-methylpiperidinium bromide;Org 7402;Vecuronium Bromide Impurity 4(Vecuronium Bromide EP Impurity D);Vecuronium Bromide EP Impurity D;Vecuronium EP Impurity D
CAS No.73319-30-9

Synthetic Route by SureRoute

1. ACDOLF988 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACDSBJ263 route compound structure diagram
    ACDSBJ26313522-16-2
  4. Then
  5. ACDOLF988 route product structure diagram
    ACDOLF98873319-30-9
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2. ACDOLF988 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACDOLF988 route product structure diagram
    ACDOLF98873319-30-9
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